CID 55284419

1638333-57-9

Structural Information

Molecular Formula
C6H10N2O
SMILES
C1[C@@H]2[C@@H](C2C(=O)N)CN1
InChI
InChI=1S/C6H10N2O/c7-6(9)5-3-1-8-2-4(3)5/h3-5,8H,1-2H2,(H2,7,9)/t3-,4+,5?
InChIKey
GLEUKLIFNNEVEM-NGQZWQHPSA-N
Compound name
(1R,5S)-3-azabicyclo[3.1.0]hexane-6-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

16
Patents

126.079315 Da
Monoisotopic Mass

-1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 127.086591 125.9
[M+Na]+ 149.068533 135.3
[M-H]- 125.072039 128.2
[M+NH4]+ 144.113138 143.5
[M+K]+ 165.042473 131.4
[M+H-H2O]+ 109.076575 120.4
[M+HCOO]- 171.077516 146.1
[M+CH3COO]- 185.093166 174.2
[M+Na-2H]- 147.053981 130.3
[M]+ 126.07876642 124.0
[M]- 126.07986358 124.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe